cyclobutanamine;dihydrochloride

C4H11Cl2N — CID 69167848

IUPACcyclobutanamine;dihydrochloride
SMILESCl.Cl.NC1CCC1
InChIInChI=1S/C4H9N.2ClH/c5-4-2-1-3-4;;/h4H,1-3,5H2;2*1H
InChIKeyORJNTUATJNGJEN-UHFFFAOYSA-N
MW144.04 g/mol
LogP1.34
Rot. Bonds

About cyclobutanamine;dihydrochloride

cyclobutanamine;dihydrochloride (PubChem CID 69167848) has the molecular formula C4H11Cl2N and a molecular weight of 144.04 g/mol. Its IUPAC name is cyclobutanamine;dihydrochloride.

Molecular Properties

Compound Namecyclobutanamine;dihydrochloride
PubChem CID69167848
Molecular FormulaC4H11Cl2N
Molecular Weight144.04 g/mol
Exact Mass143.03
IUPAC Namecyclobutanamine;dihydrochloride
SMILESCl.Cl.NC1CCC1
InChIInChI=1S/C4H9N.2ClH/c5-4-2-1-3-4;;/h4H,1-3,5H2;2*1H
InChIKeyORJNTUATJNGJEN-UHFFFAOYSA-N
XLogP1.34
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.04
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclobutanamine;dihydrochloride?
The IUPAC name of cyclobutanamine;dihydrochloride (CID 69167848) is cyclobutanamine;dihydrochloride.
What is the SMILES notation for cyclobutanamine;dihydrochloride?
The canonical SMILES for cyclobutanamine;dihydrochloride is Cl.Cl.NC1CCC1.
What is the InChIKey of cyclobutanamine;dihydrochloride?
The InChIKey is ORJNTUATJNGJEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N.2ClH/c5-4-2-1-3-4;;/h4H,1-3,5H2;2*1H.
What are the key properties of cyclobutanamine;dihydrochloride?
cyclobutanamine;dihydrochloride has a molecular weight of 144.04 g/mol, XLogP of 1.34, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutanamine;dihydrochloride is sourced from PubChem (CID 69167848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).